2-Propenoic acid, 3-(2-furanyl)-, 2-methylpropyl ester
Basic information
- CAS
68480-18-2- Standard SMILES
CC(C)COC(=O)/C=C/c1ccco1- InChIKey
MXXZZSWRRDGWLK-AATRIKPKSA-N- Molecular formula
- C11H14O3
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.0942943
Names & identifiers
- Preferred name
- 2-Propenoic acid, 3-(2-furanyl)-, 2-methylpropyl ester
- IUPAC
- 2-methylpropyl (E)-3-(furan-2-yl)prop-2-enoate
Names & synonyms
Isobutyl 3-(2-furyl)acrylate2-Propenoic acid, 3-(2-furanyl)-, 2-methylpropyl ester52RK2ED8WFEINECS 270-895-2DTXSID3071569iso-Butyl .beta.-2-furyl-acrylateIsobutyl 3-(2-furyl)-2-propenoate2-METHYLPROPYL 3-(2-FURANYL)-2-PROPENOATERefChem:89275DTXCID3046031iso-Butyl beta-2-furyl-acrylateMXXZZSWRRDGWLK-AATRIKPKSA-N
Show more names
68480-18-22-methylpropyl 3-(furan-2-yl)prop-2-enoateUNII-52RK2ED8WFAKOS006243394NS00036608
Database identifiers
- CAS
68480-18-2- PubChem CID
- 5371129
- UNII
- 52RK2ED8WF
- EC Number
- 270-895-2
- Nikkaji
- J326.643E
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 209
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 2-Propenoic acid, 3-(2-furanyl)-, 2-methylpropyl ester
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Propenoic acid, 3-(2-furanyl)-, 2-methylpropyl ester: INACTIVE
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Compound notes
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